2-[[3,4-bis(methylamino)phenoxy]methylamino]pyrimido[1,2-a]benzimidazole-3-carbonitrile

Systemtic Name: 2-[[3,4-bis(methylamino)phenoxy]methylamino]pyrimido[1,2-a]benzimidazole-3-carbonitrile Openeye Name: 2-[[3,4-bis(methylamino)phenoxy]methylamino]pyrimido[1,2-a]benzimidazole-3-carbonitrile CAS Name: 2-[[3,4-bis(methylamino)phenoxy]methylamino]-3-pyrimido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-[[3,4-bis(methylamino)phenoxy]methylamino]pyrimido[1,2-a]benzimidazole-3-carbonitrile Traditional Name: 2-[[3,4-bis(methylamino)phenoxy]methylamino]pyrimido[1,2-a]benzimidazole-3-carbonitrile Formula: C20H19N7O MolecularWeight: 373.41116

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)OCNC2=NC3=NC4=CC=CC=C4N3C=C2C#N)NC

Isomeric SMILES

CNC1=C(C=C(C=C1)OCNC2=NC3=NC4=CC=CC=C4N3C=C2C#N)NC

InChI

InChI=1S/C20H19N7O/c1-22-15-8-7-14(9-17(15)23-2)28-12-24-19-13(10-21)11-27-18-6-4-3-5-16(18)25-20(27)26-19/h3-9,11,22-23H,12H2,1-2H3,(H,24,25,26)